SCHEMBL6460071

SCHEMBL6460071

CCCC1CC[C@@H]2C[C@H](c3ccc(-c4cc(F)c(OC(F)(F)F)c(F)c4)c(F)c3)CC[C@@H]2C1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.32
FASN P49327 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MEN1 O00255 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6460074 1.00 CYP2C9 (0.32) CYP2C9FASNALDH1A1LMNAMAPT
SCHEMBL6456934 0.94 FASN (0.31) FASN
SCHEMBL6456937 0.94 FASN (0.31) FASN
SCHEMBL6458487 0.93 FASN (0.31) FASNMAPT
SCHEMBL6458493 0.93 FASN (0.31) FASNMAPT
SCHEMBL6452726 0.92 GAA (0.32) FASNMAPT
SCHEMBL6453478 0.92 GAA (0.32) FASNMAPT
SCHEMBL6453471 0.92 GAA (0.32) FASNMAPT
SCHEMBL6452731 0.92 GAA (0.32) FASNMAPT
SCHEMBL6458340 0.92 FASN (0.31) FASN

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed